TY - STD TI - Bunn CW: Chemical Crystallography. An Introduction to Optical and X-Ray Methods. Oxford at the Clarendon Press; 1946. ., [https://archive.org/details/chemicalcrystall032644mbp] UR - https://archive.org/details/chemicalcrystall032644mbp ID - ref1 ER - TY - STD TI - Hough E, Hursthouse MB, Neidle S, Rogers D: Crystallographic studies of fusicoccin and two mercuribromide derivatives. Chem Comm 1968, 1197., ID - ref2 ER - TY - JOUR AU - Hursthouse, M. B. AU - Jones, R. A. AU - Malik, K. M. A. AU - Wilkinson, G. PY - 1979 DA - 1979// TI - Synthesis and X-ray crystal-structures of hexakis(trimethylphosphine)tris-mu-methylene-diruthenium(iii) and its mono-cationic and dicationic derivatives, hexakis(trimethylphosphine)-mu-methyl-bis-mu-methylene-diruthenium(iii) tetrafluoroborate and hexakis(trimethylphosphine)bis-mu-methylene-diruthenium(iii) bistetrafluoroborate JO - J Am Chem Soc VL - 101 UR - https://doi.org/10.1021/ja00509a020 DO - 10.1021/ja00509a020 ID - Hursthouse1979 ER - TY - STD TI - Hursthouse MB, Rodesiler PF: Crystal and Molecular Structure of Tris(hexamethyldisilylamido) iron(III). J.C.S. Dalton; 1972:2100. ID - ref4 ER - TY - STD TI - Pauling L: The Nature of the Chemical Bond. Cornell University Press; 1939. This book puts in prime place the pioneering work of Walter Heitler and Fritz London (also of Dispersion Forces fame). ID - ref5 ER - TY - STD TI - Coulson CA: Valence. Oxford at the Clarendon Press; 1952. This book also puts in place the original work of Friedrich Hund, Robert Mulliken, John Slater and John Lennard Jones. ID - ref6 ER - TY - STD TI - Molecular Modelling. Many contributing authors, 1980’s onwards. Initially, methods based on “Molecular Mechanics”, subsequently redefined to include all computational and graphics techniques available to build a molecule from a model or a drawing. ID - ref7 ER - TY - JOUR AU - Pauling, L. PY - 1935 DA - 1935// TI - The structure and entropy of ice and of other crystals with some randomness of atomic arrangement JO - J Am Chem Soc VL - 57 UR - https://doi.org/10.1021/ja01315a102 DO - 10.1021/ja01315a102 ID - Pauling1935 ER - TY - JOUR AU - Powell, H. M. AU - Palin, D. E. PY - 1945 DA - 1945// TI - Hydrogen bond linking of quinol molecules JO - Nature (London) VL - 156 UR - https://doi.org/10.1038/156334a0 DO - 10.1038/156334a0 ID - Powell1945 ER - TY - JOUR AU - Wells, A. F. PY - 1954 DA - 1954// TI - The geometrical basis of crystal chemistry. Part 1 JO - Acta Cryst VL - 7 UR - https://doi.org/10.1107/S0365110X5400182X DO - 10.1107/S0365110X5400182X ID - Wells1954 ER - TY - JOUR AU - Pauling, L. AU - Corey, R. B. PY - 1950 DA - 1950// TI - Two hydrogen-bonded spiral configurations of the polypeptide chain JO - J Am Chem Soc VL - 72 UR - https://doi.org/10.1021/ja01167a545 DO - 10.1021/ja01167a545 ID - Pauling1950 ER - TY - BOOK AU - Hamilton, W. C. AU - Ibers, J. A. PY - 1968 DA - 1968// TI - Hydrogen Bonding in Solids PB - W.A. Benjamin CY - New York ID - Hamilton1968 ER - TY - STD TI - Jeffrey GA: An Introduction to Hydrogen Bonding. Oxford University Press; 1997. ID - ref13 ER - TY - JOUR AU - Etter, M. C. PY - 1982 DA - 1982// TI - A new role for hydrogen-bond acceptors in influencing packing patterns of carboxylic acids and amides JO - J Am Chem Soc VL - 104 UR - https://doi.org/10.1021/ja00368a031 DO - 10.1021/ja00368a031 ID - Etter1982 ER - TY - JOUR AU - Etter, M. C. PY - 1990 DA - 1990// TI - Encoding and decoding hydrogen-bond patterns of organic compounds: Acc JO - Chem Res VL - 23 UR - https://doi.org/10.1021/ar00172a005 DO - 10.1021/ar00172a005 ID - Etter1990 ER - TY - JOUR AU - Threlfall, T. L. PY - 1995 DA - 1995// TI - Analysis of organic polymorphs: a review JO - Analyst VL - 120 UR - https://doi.org/10.1039/an9952002435 DO - 10.1039/an9952002435 ID - Threlfall1995 ER - TY - JOUR AU - Lehn, J. M. PY - 1993 DA - 1993// TI - Supramolecular chemistry JO - Science VL - 260 UR - https://doi.org/10.1126/science.8511582 DO - 10.1126/science.8511582 ID - Lehn1993 ER - TY - JOUR AU - Schmidt, G. M. J. PY - 1971 DA - 1971// TI - Photodimerization in the solid state JO - Pure Appl Chem VL - 27 UR - https://doi.org/10.1351/pac197127040647 DO - 10.1351/pac197127040647 ID - Schmidt1971 ER - TY - STD TI - Crystal Engineering. Form meets Function. Crystal Engineering Conference. Waterville Valley, NH, USA. June 1-6, 2014[http://www.grc.org/programs.aspx?year=2014&program=crystal] UR - http://www.grc.org/programs.aspx?year=2014&program=crystal ID - ref19 ER - TY - STD TI - Co-ordinating Polymers and Metal Organic Frameworks: Terminology and Guidelines. IUPAC Project No. 2009-012-2-200[www.iupac.org/web/ins/2009-012-2-200] UR - http://www.iupac.org/web/ins/2009-012-2-200 ID - ref20 ER - TY - STD TI - Cejka J (Ed): Metal-Organic Frameworks Applications from Catalysis to Gas Storage Wiley-VCH; 2011. ISBN 978-3-527-32870-3. ID - ref21 ER - TY - JOUR AU - Korisanszky, T. S. AU - Coppens, P. PY - 2011 DA - 2011// TI - Chemical applications of x-ray charge density analysis JO - Chem Rev VL - 101 UR - https://doi.org/10.1021/cr990112c DO - 10.1021/cr990112c ID - Korisanszky2011 ER - TY - STD TI - Gatti C, Macchi P (Eds): Modern Charge Density Analysis.Springer; 2012. ISBN 978-90-481-3836-4. ID - ref23 ER - TY - JOUR AU - Macchi, P. PY - 2013 DA - 2013// TI - Modern charge density studies: the entanglement of experiment and theory JO - Crystallogr Rev VL - 19 UR - https://doi.org/10.1080/0889311X.2013.785538 DO - 10.1080/0889311X.2013.785538 ID - Macchi2013 ER - TY - JOUR AU - Deutsch, M. AU - Gillon, B. AU - Claiser, N. AU - Gillet, J. M. AU - Lecomte, C. AU - Souhassou, M. PY - 2014 DA - 2014// TI - First spin-resolved electron distributions in crystals from combined polarized neutron and X-ray diffraction experiments JO - IUCrJ VL - 1 UR - https://doi.org/10.1107/S2052252514007283 DO - 10.1107/S2052252514007283 ID - Deutsch2014 ER - TY - STD TI - Test of crystal structure prediction of small organic molecules. First Blind Test. Acta Crystallogr. 2000, B56: 697-714. ID - ref26 ER - TY - STD TI - Test of crystal structure prediction of small organic molecules. Second blind test. Acta Crystallogr. 2002, B58: 647-661. ID - ref27 ER - TY - STD TI - Test of crystal structure prediction of small organic molecules. Third blind test. Acta Crystallogr. 2005, B61: 511-527. ID - ref28 ER - TY - STD TI - Test of crystal structure prediction of small organic molecules. Fourth blind test. Acta Crystallogr. 2009, B65: 107-125. ID - ref29 ER - TY - STD TI - Test of crystal structure prediction of small organic molecules. Fifth blind test. Acta Crystallogr. 2011, B67: 535-551. ID - ref30 ER - TY - STD TI - Various Authors: Test of crystal structure prediction of small organic molecules. Sixth blind test (2014-2015). Now in progress. ; ᅟ. ID - ref31 ER - TY - JOUR AU - Gavezzotti, A. PY - 2008 DA - 2008// TI - Non-conventional bonding between organic molecules. The ‘halogen bond’ in crystalline systems JO - Mol Phys VL - 106 UR - https://doi.org/10.1080/00268970802060674 DO - 10.1080/00268970802060674 ID - Gavezzotti2008 ER - TY - JOUR AU - Gavezzotti, A. PY - 2011 DA - 2011// TI - Efficient computer modeling of organic materials. The atom–atom, Coulomb–London–Pauli (AA-CLP) model for intermolecular electrostatic-polarization, dispersion and repulsion energies JO - New J Chem VL - 35 UR - https://doi.org/10.1039/c0nj00982b DO - 10.1039/c0nj00982b ID - Gavezzotti2011 ER - TY - JOUR AU - Katrusiak, A. PY - 2008 DA - 2008// TI - High pressure crystallography JO - Acta Crystallogr VL - A64 UR - https://doi.org/10.1107/S0108767307061181 DO - 10.1107/S0108767307061181 ID - Katrusiak2008 ER - TY - STD TI - Hatcher LE, Raithby PR: Dynamic single crystal diffraction studies using synchrotron radiation. J Coord Chem 2014, ., [http://dx.doi.org/10.1016/j.ccr.2014.02.621] UR - http://dx.doi.org/10.1016/j.ccr.2014.02.621 ID - ref35 ER - TY - STD TI - IUCr: Crystallographic Software List. [www.iucr.org/resources/otherdirectories] UR - http://www.iucr.org/resources/otherdirectories ID - ref36 ER - TY - STD TI - IUCR Website – list of all crystallographic databases. ., [www.iucr.org/resources/data] UR - http://www.iucr.org/resources/data ID - ref37 ER - TY - JOUR AU - Threlfall TL, G. T. AU - Hursthouse MB, M. B. PY - 2012 DA - 2012// TI - XPac dissimilarity parameters as quantitative descriptors of isostructurality: the case of fourteen 4,5-substituted benzenesulfonamido-2-pyridines obtained by substituent interchange involving CF3/I/Br/Cl/F/Me/H JO - Cryst Eng Comm VL - 14 UR - https://doi.org/10.1039/c2ce25508a DO - 10.1039/c2ce25508a ID - Threlfall TL2012 ER - TY - JOUR AU - Gelbrich, T. AU - Hursthouse, M. B. PY - 2005 DA - 2005// TI - A versatile procedure for the identification, description and quantification of structural similarity in molecular crystals JO - Cryst Eng Comm VL - 7 UR - https://doi.org/10.1039/b502484f DO - 10.1039/b502484f ID - Gelbrich2005 ER -